2-[2,6-bis(3-chlorophenyl)-4-(dodecylcarbamoyl)phenoxy]ethanoic acid

Systemtic Name: 2-[2,6-bis(3-chlorophenyl)-4-(dodecylcarbamoyl)phenoxy]ethanoic acid Openeye Name: 2-[2,6-bis(3-chlorophenyl)-4-(dodecylcarbamoyl)phenoxy]acetic acid CAS Name: 2-[2,6-bis(3-chlorophenyl)-4-[(dodecylamino)-oxomethyl]phenoxy]acetic acid IUPAC Name: 2-[2,6-bis(3-chlorophenyl)-4-(dodecylcarbamoyl)phenoxy]acetic acid Traditional Name: 2-[2,6-bis(3-chlorophenyl)-4-(laurylcarbamoyl)phenoxy]acetic acid Formula: C33H39Cl2NO4 MolecularWeight: 584.57306

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCNC(=O)C1=CC(=C(C(=C1)C2=CC(=CC=C2)Cl)OCC(=O)O)C3=CC(=CC=C3)Cl

Isomeric SMILES

CCCCCCCCCCCCNC(=O)C1=CC(=C(C(=C1)C2=CC(=CC=C2)Cl)OCC(=O)O)C3=CC(=CC=C3)Cl

InChI

InChI=1S/C33H39Cl2NO4/c1-2-3-4-5-6-7-8-9-10-11-18-36-33(39)26-21-29(24-14-12-16-27(34)19-24)32(40-23-31(37)38)30(22-26)25-15-13-17-28(35)20-25/h12-17,19-22H,2-11,18,23H2,1H3,(H,36,39)(H,37,38)